N-(3-chloro-4-methoxyphenyl)-N'-(4-{[2-methyl-6-(4-methylanilino)pyrimidin-4-yl]amino}phenyl)urea
Chemical Structure Depiction of
N-(3-chloro-4-methoxyphenyl)-N'-(4-{[2-methyl-6-(4-methylanilino)pyrimidin-4-yl]amino}phenyl)urea
N-(3-chloro-4-methoxyphenyl)-N'-(4-{[2-methyl-6-(4-methylanilino)pyrimidin-4-yl]amino}phenyl)urea
Compound characteristics
| Compound ID: | D638-0047 |
| Compound Name: | N-(3-chloro-4-methoxyphenyl)-N'-(4-{[2-methyl-6-(4-methylanilino)pyrimidin-4-yl]amino}phenyl)urea |
| Molecular Weight: | 488.98 |
| Molecular Formula: | C26 H25 Cl N6 O2 |
| Smiles: | Cc1ccc(cc1)Nc1cc(Nc2ccc(cc2)NC(Nc2ccc(c(c2)[Cl])OC)=O)nc(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 6.8268 |
| logD: | 6.0472 |
| logSw: | -6.4831 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 77.315 |
| InChI Key: | PEMWKGAMRJOVSR-UHFFFAOYSA-N |